ethyl 4-[1-(phenylmethyl)sulfonylpiperidin-4-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-(phenylmethyl)sulfonylpiperidin-4-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(1-benzylsulfonylpiperidine-4-carbonyl)piperazine-1-carboxylate CAS Name: 4-[oxo-[1-(phenylmethyl)sulfonyl-4-piperidinyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(1-benzylsulfonylpiperidine-4-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(1-benzylsulfonylisonipecotoyl)piperazine-1-carboxylic acid ethyl ester Formula: C20H29N3O5S MolecularWeight: 423.52636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C20H29N3O5S/c1-2-28-20(25)22-14-12-21(13-15-22)19(24)18-8-10-23(11-9-18)29(26,27)16-17-6-4-3-5-7-17/h3-7,18H,2,8-16H2,1H3